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Information card for entry 4065609
Preview
Coordinates | 4065609.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C29 H45 N2 O Sc Si2 |
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Calculated formula | C29 H45 N2 O Sc Si2 |
SMILES | [Sc]1([n]2cccc3cccc(N1c1c(cccc1C)C)c23)([O]1CCCC1)(C[Si](C)(C)C)C[Si](C)(C)C |
Title of publication | Stereoselective Polymerization of Styrene with Cationic Scandium Precursors Bearing Quinolyl Aniline Ligands |
Authors of publication | Liu, Dongtao; Luo, Yunjie; Gao, Wei; Cui, Dongmei |
Journal of publication | Organometallics |
Year of publication | 2010 |
Journal volume | 29 |
Journal issue | 8 |
Pages of publication | 1916 |
a | 9.5815 ± 0.001 Å |
b | 11.3419 ± 0.0012 Å |
c | 16.1671 ± 0.0017 Å |
α | 78.288 ± 0.002° |
β | 73.593 ± 0.002° |
γ | 68.657 ± 0.002° |
Cell volume | 1559.9 ± 0.3 Å3 |
Cell temperature | 187 ± 2 K |
Ambient diffraction temperature | 187 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0913 |
Residual factor for significantly intense reflections | 0.0631 |
Weighted residual factors for significantly intense reflections | 0.1318 |
Weighted residual factors for all reflections included in the refinement | 0.1479 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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